UCSF

ZINC41537543

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 29 No

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Annotations

Vendors

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.74 9.02 -65.13 1 6 0 74 412.511 7
Lo Low (pH 4.5-6) 2.74 8.27 -44.55 2 6 1 71 413.519 7

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Analogs ( Draw Identity 99% 90% 80% 70% )